diethyl 2-[[3-(4-nitrophenyl)-3-oxidanylidene-propyl]amino]nonanedioate

Systemtic Name: diethyl 2-[[3-(4-nitrophenyl)-3-oxidanylidene-propyl]amino]nonanedioate Openeye Name: diethyl 2-[[3-(4-nitrophenyl)-3-oxo-propyl]amino]nonanedioate CAS Name: 2-[[3-(4-nitrophenyl)-3-oxopropyl]amino]nonanedioic acid diethyl ester IUPAC Name: diethyl 2-[[3-(4-nitrophenyl)-3-oxopropyl]amino]nonanedioate Traditional Name: 2-[[3-keto-3-(4-nitrophenyl)propyl]amino]azelaic acid diethyl ester Formula: C22H32N2O7 MolecularWeight: 436.49868

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCCCCC(C(=O)OCC)NCCC(=O)C1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)CCCCCCC(C(=O)OCC)NCCC(=O)C1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C22H32N2O7/c1-3-30-21(26)10-8-6-5-7-9-19(22(27)31-4-2)23-16-15-20(25)17-11-13-18(14-12-17)24(28)29/h11-14,19,23H,3-10,15-16H2,1-2H3